SCHEMBL28663271

SCHEMBL28663271

Brc1cccc(Cc2cc3cc4nc(c(Br)c5ccc([nH]5)c(Br)c5nc(c(Br)c2[nH]3)C=C5)C=C4)c1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.32
▸ STAT1 P42224 1/20 0.32
▸ USP2 O75604 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ HCAR2 Q8TDS4 1/20 0.31
▸ MAOB P27338 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30505531 0.80 STAT3 (0.38) STAT3STAT1HPGD
SCHEMBL28113306 0.80 STAT3 (0.38) STAT3STAT1HPGD
SCHEMBL30555859 0.79 STAT3 (0.37) STAT3STAT1HPGD
SCHEMBL30555833 0.79 STAT3 (0.37) STAT3STAT1HPGD
SCHEMBL29259185 0.79 STAT3 (0.37) STAT3STAT1HPGD
SCHEMBL29259623 0.79 STAT3 (0.37) STAT3STAT1HPGD
SCHEMBL8831500 0.73 STAT3 (0.50) STAT3STAT1
SCHEMBL5062037 0.70 STAT3 (0.53) STAT3STAT1
SCHEMBL224519 0.68 STAT3 (0.48) STAT3STAT1
SCHEMBL79329 0.67 STAT3 (0.50) STAT3STAT1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113698579-A Porphyrin type conjugated microporous polymer and synthesis method and application thereof 西北民族大学 2021-11-26 — — CN disclosed
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